Propylene Glycol → HCID 178488424, compound
Reaction equation
[CH3:49][CH:50]([OH:51])[CH2:52][OH:53].[CH3:54][CH:55]([CH2:56][OH:57])[OH:58].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[o:8][c:9](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1.[Cl:25][c:26]1[c:27]2[c:28](-[c:29]3[cH:30][cH:31][c:32]([CH2:33][CH3:34])[cH:35][cH:36]3)[c:37](-[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[o:44][c:45]2[n:46][cH:47][n:48]1>>[c:2]1([O:51][CH:50]([CH3:49])[CH2:52][OH:53])[c:3]2[c:4]([n:5][cH:6][n:7]1)[o:8][c:9](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1Participants
4
Sources & evidence
- ORD record
- ord-33ad246db9b744dc921faceeac49b20a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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